CID 28606919

1,1-difluoro-n-methylmethanesulfonamide

Structural Information

Molecular Formula

C₂H₅F₂NO₂S

SMILES

CNS(=O)(=O)C(F)F

InChI

InChI=1S/C2H5F2NO2S/c1-5-8(6,7)2(3)4/h2,5H,1H3

InChIKey

RGTUKHBIFAVALX-UHFFFAOYSA-N

Compound name

1,1-difluoro-N-methylmethanesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 145.0009 Da
Monoisotopic Mass: 0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	146.00818	126.6
[M+Na]+	167.99012	133.3
[M+NH4]+	163.03472	132.5
[M+K]+	183.96406	128.8
[M-H]-	143.99362	122.3
[M+Na-2H]-	165.97557	128.1
[M]+	145.00035	126.3
[M]-	145.00145	126.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe